(16α,17Beta)-3,16-Dihydroxyestra-1(10),2,4-Trien-17-Yl Beta-D-Glucopyranosiduronic Acid
Properties
| Property | Value |
|---|---|
| Formula | C24H32O9 |
| IUPAC Name | (2s,3s,4s,5r,6r)-6-[[(8s,9r,13s,14r,16r,17r)-3,16-dihydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]oxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid |
| Molecular Mass | 464.505 g·mol−1 |
| Heat of Formation | -1679.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.25 ± 1.08 D |
| Volume | 534.69 Å 3 |
| Surface Area | 426.9 Å 2 |
| HOMO Energy | -8.99 ± 0.55 eV |
| LUMO Energy | -0.28 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | CZGFLAQOJPXVRV-ATNWMKHGSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |